Browsing Kimya Bölümü by Subject "Computational approach"
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The design of push-pull substituted coronene molecules for optoelectronic applications
(Elseiver, 01.06.2023)The optoelectronic and electronic properties of coronene ([6]circulene) and push-pull coronene molecules were predicted by using different computational chemistry programs. For this aim, the electron/hole reorganization ...